propan-2-yl 4-[2-[2-cyanoethyl-(2-fluorophenyl)amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: propan-2-yl 4-[2-[2-cyanoethyl-(2-fluorophenyl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: isopropyl 4-[2-[N-(2-cyanoethyl)-2-fluoro-anilino]-2-oxo-ethoxy]benzoate CAS Name: 4-[2-[N-(2-cyanoethyl)-2-fluoroanilino]-2-oxoethoxy]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[2-[N-(2-cyanoethyl)-2-fluoroanilino]-2-oxoethoxy]benzoate Traditional Name: 4-[2-[N-(2-cyanoethyl)-2-fluoro-anilino]-2-keto-ethoxy]benzoic acid isopropyl ester Formula: C21H21FN2O4 MolecularWeight: 384.400843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)OCC(=O)N(CCC#N)C2=CC=CC=C2F

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)OCC(=O)N(CCC#N)C2=CC=CC=C2F

InChI

InChI=1S/C21H21FN2O4/c1-15(2)28-21(26)16-8-10-17(11-9-16)27-14-20(25)24(13-5-12-23)19-7-4-3-6-18(19)22/h3-4,6-11,15H,5,13-14H2,1-2H3